Sulfuric Acid

SCHEMBL6737852

CCC(C)c1ccc(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(C(C)CC)c(C(C)CC)c2C(C)CC)c(C(C)CC)c1C(C)CC.O=S(=O)(O)O

nearest known ligand 0.41

Known targets — ChEMBL curated mechanism

ADRA1A ADRA1B ADRA1D ADRA2A ADRA2B ADRA2C ADRB1 ADRB2 ADRB3 CALCRL CHRM1 CHRM2 CHRM3 F2R MAOA MAOB MAP2K1 MAP2K2 NTRK1 NTRK2 NTRK3 OPRD1 OPRK1 OPRM1 P2RY12 PKLR SCN10A SCN11A SCN1A SCN2A SCN3A SCN4A SCN5A SCN7A SCN8A SCN9A SLC18A2 SLC6A2 SLC6A3 TLR7 TLR9 TUBA1A TUBA1B TUBA1C TUBA3C TUBA3E TUBA4A TUBB TUBB1 TUBB2A TUBB2B TUBB3 TUBB4A TUBB4B TUBB6 TUBB8 dacA dacB dacC folA ftsI mrcA mrcB mrdA pol rplA rplB rplC rplD rplE rplF rplI rplJ rplK rplL rplM rplN rplO rplP rplQ rplR rplS rplT rplU rplV rplW rplX rplY rpmA rpmB rpmB1 rpmB2 rpmC rpmD rpmE rpmE2 rpmF rpmG rpmG1 rpmG2 rpmH rpmI rpmJ rpmJ2 rpsA rpsB rpsC rpsD rpsE rpsF rpsG rpsH rpsI rpsJ rpsK rpsL rpsM rpsN rpsO rpsP rpsQ rpsR rpsR1 rpsR2 rpsS rpsT rpsU rpsZ ykgM ykgO

The experimentally established mechanism targets of Sulfuric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	HTT	P42858	3/20	0.41

▸	KDM4E	B2RXH2	8/20	0.37

▸	ALDH1A1	P00352	6/20	0.37

▸	LMNA	P02545	3/20	0.37

▸	SMN1; SMN2	Q16637	2/20	0.37

▸	KMT2A	Q03164	4/20	0.35

▸	PTK2B	Q14289	1/20	0.35

▸	MAPT	P10636	1/20	0.34

▸	MEN1	O00255	3/20	0.34

▸	NPSR1	Q6W5P4	1/20	0.34

▸	TDP1	Q9NUW8	1/20	0.34

▸	S1PR3	Q99500	1/20	0.33

▸	L3MBTL1	Q9Y468	1/20	0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compound	similarity	top predicted	shared targets
Ammonia Solution, Strong SCHEMBL10965095	0.92	HTT (0.39)	HTTKDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL11682514	0.71	TSHR (0.50)	KDM4EALDH1A1SMN1; SMN2MAPTNPSR1
SCHEMBL2098085	0.71	INPPL1 (0.42)	KDM4EALDH1A1
SCHEMBL16044889	0.67	TSHR (0.38)	ALDH1A1LMNA
SCHEMBL11692058	0.65	TSHR (0.39)	ALDH1A1LMNAMAPT
SCHEMBL909852	0.65	TSHR (0.55)	KDM4EALDH1A1LMNAKMT2AMAPT
SCHEMBL28403113	0.62	HTT (0.43)	HTTKDM4EALDH1A1LMNASMN1; SMN2
Benzene SCHEMBL1840471	0.62	TSHR (0.57)	ALDH1A1
SCHEMBL23188842	0.62	SMN1; SMN2 (0.40)	HTTKDM4ESMN1; SMN2KMT2AMAPT
SCHEMBL22261742	0.61	KDM4E (0.47)	KDM4EALDH1A1LMNASMN1; SMN2KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20040249034-A1	Aqueous copolymer dispersions, process for preparing them, and compositions comprising them for coatings	CELANESE EMULSIONS GMBH (DE)	2004-12-09	—	—	US	disclosed